(4-methoxyphenyl) 3-methyl-2-(octadecanoylamino)butanoate

Systemtic Name: (4-methoxyphenyl) 3-methyl-2-(octadecanoylamino)butanoate Openeye Name: (4-methoxyphenyl) 3-methyl-2-(octadecanoylamino)butanoate CAS Name: 3-methyl-2-(1-oxooctadecylamino)butanoic acid (4-methoxyphenyl) ester IUPAC Name: (4-methoxyphenyl) 3-methyl-2-(octadecanoylamino)butanoate Traditional Name: 3-methyl-2-stearamido-butyric acid (4-methoxyphenyl) ester Formula: C30H51NO4 MolecularWeight: 489.73024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NC(C(C)C)C(=O)OC1=CC=C(C=C1)OC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NC(C(C)C)C(=O)OC1=CC=C(C=C1)OC

InChI

InChI=1S/C30H51NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28(32)31-29(25(2)3)30(33)35-27-23-21-26(34-4)22-24-27/h21-25,29H,5-20H2,1-4H3,(H,31,32)